SCHEMBL27474368

SCHEMBL27474368

C[Si](C)(CN)c1ccccc1.[Zr]

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.42
ESR1 P03372 1/20 0.38
ESR2 Q92731 1/20 0.38
LOXL2 Q9Y4K0 2/20 0.36
TAAR1 Q96RJ0 7/20 0.34
NR1H2 P55055 2/20 0.34
NR1H3 Q13133 2/20 0.34
HTR2A P28223 2/20 0.33
MAOA P21397 2/20 0.33
CYP2A6 P11509 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MGAM O43451 1/20 0.33
MAOB P27338 1/20 0.33
NOTUM Q6P988 3/20 0.32
DPP4 P27487 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL2007179 0.97 MAPT (0.44) MAPTESR1ESR2LOXL2TAAR1
Fluoride SCHEMBL27920006 0.95 MAPT (0.42) MAPTESR1ESR2LOXL2TAAR1
Hydrochloric Acid SCHEMBL16880772 0.95 MAPT (0.42) MAPTESR1ESR2LOXL2TAAR1
SCHEMBL2012877 0.78 MAPT (0.41) MAPTESR1ESR2LOXL2TAAR1
SCHEMBL9339400 0.77 ESR1 (0.39) MAPTESR1ESR2LOXL2TAAR1
SCHEMBL9217667 0.76 MAPT (0.47) MAPTESR1ESR2NR1H2NR1H3
SCHEMBL3865502 0.75 MGAM (0.40) MAPTESR1ESR2LOXL2TAAR1
SCHEMBL9226507 0.74 MAPT (0.45) MAPTESR1ESR2NR1H2NR1H3
SCHEMBL2008775 0.73 TAAR1 (0.39) TAAR1HTR2ACYP2A6MAOBNOTUM
SCHEMBL2006055 0.73 LOXL2 (0.42) MAPTLOXL2TAAR1NR1H2NR1H3

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1174205-A Carrier catalyst system, its prep, and use in polymerization of olefines thereof HOECHST AG (DE) 1998-02-25 CN disclosed